Hexadeca-7,11-dienyl acetate
Basic information
- CAS
50933-33-0- Standard SMILES
CCCCC=CCCC=CCCCCCCOC(C)=O- InChIKey
BXJHOKLLMOYSRQ-UHFFFAOYSA-N- Molecular formula
- C18H32O2
- Average molar mass
- 280.4 g/mol
- Monoisotopic mass
- 280.24023026
Names & identifiers
- Preferred name
- Hexadeca-7,11-dienyl acetate
- IUPAC
- hexadeca-7,11-dienyl acetate
- English name
- GOSSYPLURE
- Molecular formula
- C18H32O2
- Molecular weight
- 280.45
Names & synonyms
Hexadeca-7,11-dienyl acetateRefChem:785933[(7E,11E)-hexadeca-7,11-dienyl] acetateHexadeca-7,11-dien-1-yl acetateCIS-7, CIS-11-HEXADECADIENYL ACETATE7,11-hexadecadienyl acetateSCHEMBL168363orb16970657Z11E-16Ac7Z11Z-16AcDTXSID40860620Z7Z11-16Ac;
Show more names
nomatepbwGOSSYPLURESelibate PBWPherocon PBWgossyplureh.f.7Z11Z-16Ac/7Z11E-16Ac7,11-hexadecadien-1-ol,acetate7,11-Hexadecadien-1-ol, 1-acetate
NS00088679[(7Z,11Z)-hexadeca-7,11-dienyl] acetate;Z7-23C;
Database identifiers
- CAS
50933-33-0- PubChem CID
- 39848
- DTXSID
DTXSID40860620- EC Number
- 256-857-8
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 14
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 267
Physicochemical properties
- Melting point
- 25 ℃ · <25℃
- Henry's Law Constant
- 6.6 · 6.6×10-2 mol/(m3Pa) at 25℃, HSDB (2015)
- Stability
- Light Sensitive
- LogP
- 6.986 · 6.986 (est)
- CAS DataBase Reference
- 50933 · 50933-33-0
- FDA UNII
- 131 Z40260G · 131Z40260G
- EPA Substance Registry System
- Gossyplure (50933-33-0)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H413-H335
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
- TSCA
- TSCA listed
- Hazardous Substances Data
- 50933 · 50933-33-0(Hazardous Substances Data)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 66 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H413-H335
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
- Hazardous Substances Data
- 50933-33-0(Hazardous Substances Data)
Chemistry & industry
Applications
Uses7,11-Hexadecadien-1-yl Acetate is a pheromone which can be used to disrupt the mating patterns of cotton bollworms and hence control their populations. It is also a fatty acid component of the Akebia trifoliata seed.
UsesSex attractant for pink bollworm
Suppliers
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Related reactions
3 records
Compound notes
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